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Isoxazole, 3,5-bis(4-nitrophenyl)-4-phenyl-
SpectraBase Compound ID HnbiJPNZTIX
InChI InChI=1S/C21H13N3O5/c25-23(26)17-10-6-15(7-11-17)20-19(14-4-2-1-3-5-14)21(29-22-20)16-8-12-18(13-9-16)24(27)28/h1-13H
InChIKey AEQJLHGMJKWKAK-UHFFFAOYSA-N
Mol Weight 387.35 g/mol
Molecular Formula C21H13N3O5
Exact Mass 387.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7m0yKJkMfE7
Name Isoxazole, 3,5-bis(4-nitrophenyl)-4-phenyl-
Alternate Name(s) 3,5-bis(4-nitrophenyl)-4-phenylisoxazole 3,5-Di(p-nitrophenyl)-4-phenylisoxazole
CAS Registry Number 92664-15-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13N3O5
InChI InChI=1S/C21H13N3O5/c25-23(26)17-10-6-15(7-11-17)20-19(14-4-2-1-3-5-14)21(29-22-20)16-8-12-18(13-9-16)24(27)28/h1-13H
InChIKey AEQJLHGMJKWKAK-UHFFFAOYSA-N
Molecular Weight 387.351 g/mol
SMILES c1(c(onc1-c1ccc(N(=O)=O)cc1)-c1ccc(N(=O)=O)cc1)-c1ccccc1
SPLASH splash10-0f79-2906000000-bec63edb95242005be0e
Source of Spectrum B-37-1224-0
Wiley ID 1363382